N-cyclopentyl-2-methyl-5-(2-oxo-3H-1,3-thiazol-4-yl)benzenesulfonamide

C15H18N2O3S2 — CID 118732069

IUPACN-cyclopentyl-2-methyl-5-(2-oxo-3H-1,3-thiazol-4-yl)benzenesulfonamide
SMILESCc1ccc(-c2csc(=O)[nH]2)cc1S(=O)(=O)NC1CCCC1
InChIInChI=1S/C15H18N2O3S2/c1-10-6-7-11(13-9-21-15(18)16-13)8-14(10)22(19,20)17-12-4-2-3-5-12/h6-9,12,17H,2-5H2,1H3,(H,16,18)
InChIKeyMTOSVKVJWUSOTJ-UHFFFAOYSA-N
MW338.45 g/mol
LogP2.63
Rot. Bonds4

About N-cyclopentyl-2-methyl-5-(2-oxo-3H-1,3-thiazol-4-yl)benzenesulfonamide

N-cyclopentyl-2-methyl-5-(2-oxo-3H-1,3-thiazol-4-yl)benzenesulfonamide (PubChem CID 118732069) has the molecular formula C15H18N2O3S2 and a molecular weight of 338.45 g/mol. Its IUPAC name is N-cyclopentyl-2-methyl-5-(2-oxo-3H-1,3-thiazol-4-yl)benzenesulfonamide.

Molecular Properties

Compound NameN-cyclopentyl-2-methyl-5-(2-oxo-3H-1,3-thiazol-4-yl)benzenesulfonamide
PubChem CID118732069
Molecular FormulaC15H18N2O3S2
Molecular Weight338.45 g/mol
Exact Mass338.08
IUPAC NameN-cyclopentyl-2-methyl-5-(2-oxo-3H-1,3-thiazol-4-yl)benzenesulfonamide
SMILESCc1ccc(-c2csc(=O)[nH]2)cc1S(=O)(=O)NC1CCCC1
InChIInChI=1S/C15H18N2O3S2/c1-10-6-7-11(13-9-21-15(18)16-13)8-14(10)22(19,20)17-12-4-2-3-5-12/h6-9,12,17H,2-5H2,1H3,(H,16,18)
InChIKeyMTOSVKVJWUSOTJ-UHFFFAOYSA-N
XLogP2.63
TPSA79.03 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.45
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-methyl-5-(2-oxo-3H-1,3-thiazol-4-yl)benzenesulfonamide?
The IUPAC name of N-cyclopentyl-2-methyl-5-(2-oxo-3H-1,3-thiazol-4-yl)benzenesulfonamide (CID 118732069) is N-cyclopentyl-2-methyl-5-(2-oxo-3H-1,3-thiazol-4-yl)benzenesulfonamide.
What is the SMILES notation for N-cyclopentyl-2-methyl-5-(2-oxo-3H-1,3-thiazol-4-yl)benzenesulfonamide?
The canonical SMILES for N-cyclopentyl-2-methyl-5-(2-oxo-3H-1,3-thiazol-4-yl)benzenesulfonamide is Cc1ccc(-c2csc(=O)[nH]2)cc1S(=O)(=O)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-methyl-5-(2-oxo-3H-1,3-thiazol-4-yl)benzenesulfonamide?
The InChIKey is MTOSVKVJWUSOTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3S2/c1-10-6-7-11(13-9-21-15(18)16-13)8-14(10)22(19,20)17-12-4-2-3-5-12/h6-9,12,17H,2-5H2,1H3,(H,16,18).
What are the key properties of N-cyclopentyl-2-methyl-5-(2-oxo-3H-1,3-thiazol-4-yl)benzenesulfonamide?
N-cyclopentyl-2-methyl-5-(2-oxo-3H-1,3-thiazol-4-yl)benzenesulfonamide has a molecular weight of 338.45 g/mol, XLogP of 2.63, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-methyl-5-(2-oxo-3H-1,3-thiazol-4-yl)benzenesulfonamide is sourced from PubChem (CID 118732069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).